Glucocapparin
HIT214312666
sdf文件结构编辑类似物检索
HIT ID: HIT214312666
Cas No: 15592-33-3
分子式: C8H15NO9S2
分子量: 333.33
常用名: Glucocapparin
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: {[(E)-(1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanyl}ethylidene)amino]oxy}sulfonic acid
IUPAC: {[(E)-(1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanyl}ethylidene)amino]oxy}sulfonic acid
SMILES: C\C(SC1OC(CO)C(O)C(O)C1O)=N/OS(O)(=O)=O
SMILES: C\C(SC1OC(CO)C(O)C(O)C1O)=N/OS(O)(=O)=O
InChI key: UBTOEGCOMHAXGV-YCRREMRBSA-N
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